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Substance Name: Benzyl formate
RN: 104-57-4
UNII: 79GJF97O0Y
InChIKey: UYWQUFXKFGHYNT-UHFFFAOYSA-N

Classification Code

  • Mutation Data

Molecular Formula

  • C8-H8-O2

Molecular Weight

  • 136.149
 
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Names and Synonyms

Name of Substance

  • Benzyl formate

Synonyms

  • 4-06-00-02262 (Beilstein Handbook Reference)
  • AI3-02951
  • Ameisensaeurebenzylester
  • Benzyl alcohol, formate
  • Benzyl formate
  • Benzyl formiat
  • Benzyl methanoate
  • Benzylester kyseliny mravenci
  • Benzylester kyseliny mravenci [Czech]
  • BRN 2041319
  • EINECS 203-214-4
  • FEMA No. 2145
  • Formic acid, benzyl ester
  • Formic acid, phenylmethyl ester
  • NSC 8049
  • Phenylmethyl formate
  • UNII-79GJF97O0Y

Systematic Names

  • Benzyl formate
  • Formic acid, benzyl ester
  • Formic acid, phenylmethyl ester

Superlist Name

  • Benzyl formate

Registry Numbers

CAS Registry Number

  • 104-57-4

FDA UNII

  • 79GJF97O0Y

System Generated Number

  • 0000104574

Structure Descriptors

InChI

1S/C8H8O2/c9-7-10-6-8-4-2-1-3-5-8/h1-5,7H,6H2

InChIKey

UYWQUFXKFGHYNT-UHFFFAOYSA-N

Smiles

c1(ccccc1)COC=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rabbit LD50 skin 2gm/kg (2000mg/kg)   Food and Cosmetics Toxicology. Vol. 11, Pg. 1019, 1973.
rat LD50 oral 1400mg/kg (1400mg/kg)   Food and Cosmetics Toxicology. Vol. 11, Pg. 1019, 1973.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Boiling Point 203 deg C   EXP
log P (octanol-water) 1.530 (none)   EST
Atmospheric OH Rate Constant 6.34E-12 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.